Glass transition of polymers in bulk, confined geometries, and near interfaces

S Napolitano, E Glynos, NB Tito - Reports on Progress in Physics, 2017 - iopscience.iop.org
When cooled or pressurized, polymer melts exhibit a tremendous reduction in molecular
mobility. If the process is performed at a constant rate, the structural relaxation time of the …

The physics of jamming for granular materials: a review

RP Behringer, B Chakraborty - Reports on Progress in Physics, 2018 - iopscience.iop.org
Granular materials consist of macroscopic grains, interacting via contact forces, and
unaffected by thermal fluctuations. They are one of a class systems that undergo jamming, ie …

Edwards statistical mechanics for jammed granular matter

A Baule, F Morone, HJ Herrmann, HA Makse - Reviews of modern physics, 2018 - APS
In 1989, Sir Sam Edwards made the visionary proposition to treat jammed granular materials
using a volume ensemble of equiprobable jammed states in analogy to thermal equilibrium …

Temperature in and out of equilibrium: A review of concepts, tools and attempts

A Puglisi, A Sarracino, A Vulpiani - Physics Reports, 2017 - Elsevier
We review the general aspects of the concept of temperature in equilibrium and non-
equilibrium statistical mechanics. Although temperature is an old and well-established …

Exploring energy landscapes

DJ Wales - Annual review of physical chemistry, 2018 - annualreviews.org
Recent advances in the potential energy landscapes approach are highlighted, including
both theoretical and computational contributions. Treating the high dimensionality of …

Energy landscapes for machine learning

AJ Ballard, R Das, S Martiniani, D Mehta… - Physical Chemistry …, 2017 - pubs.rsc.org
Machine learning techniques are being increasingly used as flexible non-linear fitting and
prediction tools in the physical sciences. Fitting functions that exhibit multiple solutions as …

Basins with tentacles

Y Zhang, SH Strogatz - Physical Review Letters, 2021 - APS
To explore basin geometry in high-dimensional dynamical systems, we consider a ring of
identical Kuramoto oscillators. Many attractors coexist in this system; each is a twisted …

100 Years of the Lennard-Jones Potential

P Schwerdtfeger, DJ Wales - Journal of Chemical Theory and …, 2024 - ACS Publications
It is now 100 years since Lennard-Jones published his first paper introducing the now
famous potential that bears his name. It is therefore timely to reflect on the many …

Numerical test of the Edwards conjecture shows that all packings are equally probable at jamming

S Martiniani, KJ Schrenk, K Ramola, B Chakraborty… - Nature physics, 2017 - nature.com
In the late 1980s, Sam Edwards proposed a possible statistical-mechanical framework to
describe the properties of disordered granular materials. A key assumption underlying the …

Predicting the phase diagram of titanium dioxide with random search and pattern recognition

A Reinhardt, CJ Pickard, B Cheng - Physical Chemistry Chemical …, 2020 - pubs.rsc.org
Predicting phase stabilities of crystal polymorphs is central to computational materials
science and chemistry. Such predictions are challenging because they first require …